cis-3-(3-(3-Hexenyloxy)-1,2,5-thiadiazol-4-yl)-1-methylpyridinium iodide

HCID 70144331

Basic information

Standard SMILES
CC/C=C\CCOc1nsnc1-c1ccc[n+](C)c1.[I-]
InChIKey
QZHWHSMSPNUXGP-MKWAYWHRSA-M
Molecular formula
C14H18IN3OS
Average molar mass
403.28 g/mol
Monoisotopic mass
403.02153

Names & identifiers

Preferred name
cis-3-(3-(3-Hexenyloxy)-1,2,5-thiadiazol-4-yl)-1-methylpyridinium iodide
IUPAC
3-[(Z)-hex-3-enoxy]-4-(1-methylpyridin-1-ium-3-yl)-1,2,5-thiadiazole iodide

Names & synonyms

SCHEMBL7609426QZHWHSMSPNUXGP-MKWAYWHRSA-Mcis-3-(3-(3-Hexenyloxy)-1,2,5-thiadiazol-4-yl)-1-methylpyridinium iodidecis-3-(4-(3-hexenyloxy)-1,2,5-thiadiazol-3-yl)-1-methylpyridinium iodidecis-3-(3-(3-Hexenyloxy)-1,2,5-thiadiazol-4-yl)-1 -methylpyridinium iodide

Database identifiers

PubChem CID
70144331

Properties

Computed structural properties

Topological polar surface area
67.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
20

Related reactions

13 records

Linked notes

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